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Theoretical Photodynamic Study of the Photoprotolytic Cycle of Firefly Oxyluciferin

Title
Theoretical Photodynamic Study of the Photoprotolytic Cycle of Firefly Oxyluciferin
Type
Article in International Scientific Journal
Year
2013
Authors
da silva, lp
(Author)
Other
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simkovitch, r
(Author)
Other
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huppert, d
(Author)
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da silva, jcge
(Author)
FCUP
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Journal
Title: ChemPhysChemImported from Authenticus Search for Journal Publications
Vol. 14
Pages: 2711-2716
ISSN: 1439-4235
Publisher: Wiley-Blackwell
Indexing
Scientific classification
FOS: Natural sciences > Chemical sciences
CORDIS: Physical sciences > Chemistry
Other information
Authenticus ID: P-006-85F
Abstract (EN): Firefly oxyluciferin presents a pH-sensitive fluorescence in aqueous solutions. Its fluorescence spectra are composed of two green peaks at different pH values, despite the enolate anion being the only emitter. A computational approach was used to further elucidate the photoprotolytic cycle of oxyluciferin and investigate its pH sensitivity. It was found that oxyluciferin forms - stacking complexes both in the ground and excited states, at basic and acidic/neutral pH. However, at different pH values, these complexes adopt a different conformation, which explains the lower energy of the emission at acidic/neutral pH, in comparison with the emission at basic pH.
Language: English
Type (Professor's evaluation): Scientific
Contact: jcsilva@fc.up.pt
No. of pages: 6
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